SCHEMBL14733168

SCHEMBL14733168

CCOC(=O)Cc1cccc(-c2cccc(Cl)n2)n1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 3/20 0.43
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
NLRP3 Q96P20 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
RAB9A P51151 3/20 0.40
CHEK1 O14757 1/20 0.40
CFTR P13569 1/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31638154 0.91 MAPT (0.47) MAPTSMN1; SMN2LMNAKMT2AMEN1
SCHEMBL1646319 0.91 MAPT (0.47) MAPTSMN1; SMN2LMNAKMT2AMEN1
SCHEMBL14732970 0.85 CCR1 (0.48) LMNAKMT2AMEN1CYP1A2CYP2C9
SCHEMBL14732977 0.83 KMT2A (0.44) MAPTSMN1; SMN2LMNAKMT2AMEN1
SCHEMBL14732978 0.81 LMNA (0.41) SMN1; SMN2LMNAKMT2AMEN1CYP1A2
SCHEMBL1135252 0.79 ALDH1A1 (0.48) LMNAKMT2AMEN1CYP1A2CYP2C9
SCHEMBL14677477 0.77 KMT2A (0.47) MAPTLMNAKMT2AMEN1CYP1A2
SCHEMBL22070548 0.77 KMT2A (0.47) MAPTLMNAKMT2AMEN1CYP1A2
SCHEMBL22940127 0.77 PRMT5 (0.49) MAPTSMN1; SMN2LMNAKMT2AMEN1
SCHEMBL10896384 0.76 CYP4F2 (0.50) MAPTSMN1; SMN2LMNAKMT2AMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013026866-A2 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2013-02-28 WO disclosed